CID 67058696

1269615-30-6

Structural Information

Molecular Formula
C4H9N5
SMILES
CNCC1=NN(N=N1)C
InChI
InChI=1S/C4H9N5/c1-5-3-4-6-8-9(2)7-4/h5H,3H2,1-2H3
InChIKey
YABHCUGEYSRJJE-UHFFFAOYSA-N
Compound name
N-methyl-1-(2-methyltetrazol-5-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

127.08579 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.09307 124.4
[M+Na]+ 150.07501 135.4
[M+NH4]+ 145.11961 131.2
[M+K]+ 166.04895 132.5
[M-H]- 126.07851 123.8
[M+Na-2H]- 148.06046 130.2
[M]+ 127.08524 125.4
[M]- 127.08634 125.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe